3-[(2R,6R)-2,6-dimethylpiperidin-1-yl]-1,1-diphenylpropan-1-ol

C22H29NO — CID 92853219

IUPAC3-[(2R,6R)-2,6-dimethylpiperidin-1-yl]-1,1-diphenylpropan-1-ol
SMILESC[C@@H]1CCC[C@@H](C)N1CCC(O)(c1ccccc1)c1ccccc1
InChIInChI=1S/C22H29NO/c1-18-10-9-11-19(2)23(18)17-16-22(24,20-12-5-3-6-13-20)21-14-7-4-8-15-21/h3-8,12-15,18-19,24H,9-11,16-17H2,1-2H3/t18-,19-/m1/s1
InChIKeyYWUUDSJJYZRSQL-RTBURBONSA-N
MW323.48 g/mol
LogP4.58
Rot. Bonds5

About 3-[(2R,6R)-2,6-dimethylpiperidin-1-yl]-1,1-diphenylpropan-1-ol

3-[(2R,6R)-2,6-dimethylpiperidin-1-yl]-1,1-diphenylpropan-1-ol (PubChem CID 92853219) has the molecular formula C22H29NO and a molecular weight of 323.48 g/mol. Its IUPAC name is 3-[(2R,6R)-2,6-dimethylpiperidin-1-yl]-1,1-diphenylpropan-1-ol.

Molecular Properties

Compound Name3-[(2R,6R)-2,6-dimethylpiperidin-1-yl]-1,1-diphenylpropan-1-ol
PubChem CID92853219
Molecular FormulaC22H29NO
Molecular Weight323.48 g/mol
Exact Mass323.22
IUPAC Name3-[(2R,6R)-2,6-dimethylpiperidin-1-yl]-1,1-diphenylpropan-1-ol
SMILESC[C@@H]1CCC[C@@H](C)N1CCC(O)(c1ccccc1)c1ccccc1
InChIInChI=1S/C22H29NO/c1-18-10-9-11-19(2)23(18)17-16-22(24,20-12-5-3-6-13-20)21-14-7-4-8-15-21/h3-8,12-15,18-19,24H,9-11,16-17H2,1-2H3/t18-,19-/m1/s1
InChIKeyYWUUDSJJYZRSQL-RTBURBONSA-N
XLogP4.58
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.48
LogP ≤ 54.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(2,6-dimethylpiperidin-1-yl)-1,1-diphenylbutan-1-ol
CID 14810506
5-[(2S,6R)-2,6-dimethylpiperidin-1-yl]-1,1-diphenylpentan-1-ol
CID 14810520
5-[(2S,6S)-2,6-dimethylpiperidin-1-yl]-1,1-diphenylpentan-1-ol
CID 92853218
4-(2,6-dimethylpiperidin-1-yl)-2-(4-phenylphenyl)butan-2-ol
CID 57320094
4-(2,6-dimethylpiperidin-1-yl)-1-phenyl-1-pyridin-2-ylbutan-1-ol
CID 4853
(1R)-5-[(2R,6R)-2,6-dimethylpiperidin-1-yl]-1-phenyl-1-pyridin-2-ylpentan-1-ol
CID 97356694
1-(2,6-dimethylpiperidin-1-yl)-2-phenylpropan-2-amine
CID 62489691
[4-[(2S,6R)-2,6-dimethylpiperidin-1-yl]-1,1-diphenylbutyl] sulfamate
CID 54561377
1-[3-ethyl-3-(4-methylphenyl)hexyl]-2,6-dimethylpiperidine
CID 142832915
3-[(1R,5R)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl]-1,1-diphenylpropan-1-ol
CID 54583007
2-(1-methylpiperidin-4-yl)-1,1-diphenylethanol;hydrochloride
CID 54609205
(E,1S)-4-[(2S,6R)-2,6-dimethylpiperidin-1-yl]-1-phenyl-1-pyridin-2-ylbut-2-en-1-ol
CID 129374512

Frequently Asked Questions

What is the IUPAC name of 3-[(2R,6R)-2,6-dimethylpiperidin-1-yl]-1,1-diphenylpropan-1-ol?
The IUPAC name of 3-[(2R,6R)-2,6-dimethylpiperidin-1-yl]-1,1-diphenylpropan-1-ol (CID 92853219) is 3-[(2R,6R)-2,6-dimethylpiperidin-1-yl]-1,1-diphenylpropan-1-ol.
What is the SMILES notation for 3-[(2R,6R)-2,6-dimethylpiperidin-1-yl]-1,1-diphenylpropan-1-ol?
The canonical SMILES for 3-[(2R,6R)-2,6-dimethylpiperidin-1-yl]-1,1-diphenylpropan-1-ol is C[C@@H]1CCC[C@@H](C)N1CCC(O)(c1ccccc1)c1ccccc1.
What is the InChIKey of 3-[(2R,6R)-2,6-dimethylpiperidin-1-yl]-1,1-diphenylpropan-1-ol?
The InChIKey is YWUUDSJJYZRSQL-RTBURBONSA-N. The full InChI is InChI=1S/C22H29NO/c1-18-10-9-11-19(2)23(18)17-16-22(24,20-12-5-3-6-13-20)21-14-7-4-8-15-21/h3-8,12-15,18-19,24H,9-11,16-17H2,1-2H3/t18-,19-/m1/s1.
What are the key properties of 3-[(2R,6R)-2,6-dimethylpiperidin-1-yl]-1,1-diphenylpropan-1-ol?
3-[(2R,6R)-2,6-dimethylpiperidin-1-yl]-1,1-diphenylpropan-1-ol has a molecular weight of 323.48 g/mol, XLogP of 4.58, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2R,6R)-2,6-dimethylpiperidin-1-yl]-1,1-diphenylpropan-1-ol is sourced from PubChem (CID 92853219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).